SCHEMBL2943710

SCHEMBL2943710

CS(=O)(=O)c1c(C(N)=O)cccc1-c1ccc(C(N)=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 4/20 0.50
▸ MKNK2 Q9HBH9 3/20 0.50
▸ BCAT2 O15382 1/20 0.45
▸ MAP4K4 O95819 1/20 0.44
▸ IKBKB O14920 3/20 0.43
▸ MAPK12 P53778 1/20 0.43
▸ CA2 P00918 2/20 0.42
▸ CA12 O43570 1/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ CA14 Q9ULX7 1/20 0.42
▸ CAMKK2 Q96RR4 2/20 0.41
▸ KEAP1 Q14145 1/20 0.41
▸ NFE2L2 Q16236 1/20 0.41
▸ CHUK O15111 3/20 0.39
▸ CREBBP Q92793 1/20 0.39
▸ INSR P06213 1/20 0.38
▸ MAPK8 P45983 1/20 0.38
▸ CHEK2 O96017 2/20 0.37
▸ PTGS2 P35354 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5171102 0.88 BCAT2 (0.61) BCAT2IKBKBKEAP1NFE2L2CHUK
SCHEMBL29941849 0.78 MKNK1 (0.55) MKNK1MKNK2BCAT2IKBKBMAPK12
SCHEMBL8668460 0.77 BCAT2 (0.74) MKNK1MKNK2BCAT2KEAP1NFE2L2
SCHEMBL6303170 0.76 MKNK1 (0.54) MKNK1MKNK2MAP4K4CA2CA12
SCHEMBL3453931 0.76 HNF4A (0.53) MKNK1MKNK2BCAT2IKBKBMAPK12
SCHEMBL6903281 0.74 BCAT2 (0.44) BCAT2CA2CA1CA9KEAP1
SCHEMBL8517078 0.74 BRD4 (0.41) BCAT2IKBKBKEAP1NFE2L2
SCHEMBL28586126 0.73 BCAT2 (0.62) BCAT2MAP4K4IKBKBCHUKPTGS2
SCHEMBL30903647 0.73 BCAT2 (0.62) BCAT2IKBKBCA2CA12CA1
SCHEMBL17593027 0.73 BCAT2 (0.62) BCAT2IKBKBCA2CA12CA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1940786-B1 BIPHENYL DERIVATIVES AND THEIR USE IN TREATING HEPATITIS C ARROW THERAPEUTICS LTD (GB) 2010-08-18 — — EP disclosed
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